5-Methyl-2-(Nitromethyl)-1H-Benzimidazole
[CAS# 57966-07-1]

Identification

• Name: 5-Methyl-2-(Nitromethyl)-1H-Benzimidazole
• Synonyms: 5-methyl-2-(nitromethyl)-1H-benzo[d]imidazole
• Molecular Formula: C₉H₉N₃O₂
• Molecular Weight: 191.19
• CAS Registry Number: 57966-07-1
• SMILES: Cc1ccc2c(c1)[nH]c(n2)C[N+](=O)[O-]
• InChI: 1S/C9H9N3O2/c1-6-2-3-7-8(4-6)11-9(10-7)5-12(13)14/h2-4H,5H2,1H3,(H,10,11)
• InChIKey: NKHUJOUVJHWSJP-UHFFFAOYSA-N

Properties

• Density: 1.361g/cm³ (Cal.)
• Boiling point: 443.841°C at 760 mmHg (Cal.)
• Flash point: 222.227°C (Cal.)